Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate
TL;DR: Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate (CAS 119020-91-6) is a chemical compound with molecular formula C17H18O3 and molecular weight 270.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate
Also Known As: Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate, J1.875.558K, methyl 3-hydroxy-2-methyl-3,3-diphenylpropionate, Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate #, 2-Methyl-3-hydroxy-3,3-diphenylpropanoic acid methyl ester
| Molecular Formula | C17H18O3 |
|---|---|
| Molecular Weight | 270.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.12558 |
| Heavy Atoms | 20 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 119020-91-6 |
|---|---|
| SMILES | CC(C(=O)OC)C(C1=CC=CC=C1)(C2=CC=CC=C2)O |
| InChIKey | OATZMWCNULWKMS-UHFFFAOYSA-N |
Product Overview
Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate (CAS 119020-91-6), with molecular formula C17H18O3 and molecular weight 270.13 g/mol. IUPAC: methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate.
Chemical Property Profile of Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate
Property Insights of Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate. With a topological polar surface area (TPSA) of 46.5 Ų, Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
The CAS number of Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate is 119020-91-6.
What is the molecular formula of Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
The molecular formula of Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate is C17H18O3.
What is the molecular weight of Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
The molecular weight of Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate is 270.13 g/mol.
Where can I buy Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
You can request a quote for Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-hydroxy-2-methyl-3,3-diphenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.